Apcin

Base Information

Chemical Name:Apcin
CAS No.:300815-04-7
Molecular Formula:C13H14Cl3N7O4
Molecular Weight:438.65400
Hs Code.:
European Community (EC) Number:853-640-5
Nikkaji Number:J3.332.199F
ChEMBL ID:CHEMBL4455572
Mol file:300815-04-7.mol

Synonyms:apcin

Suppliers and Price of Apcin

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
Apcin
1mg
$ 95.00

Tocris
Apcin ≥98%(HPLC)
50
$ 702.00

Tocris
Apcin ≥98%(HPLC)
10
$ 171.00

DC Chemicals
Apcin >98%
1 g
$ 2400.00

ChemScene
Apcin 99.31%
10mg
$ 160.00

ChemScene
Apcin 99.31%
5mg
$ 100.00

ChemScene
Apcin 99.31%
50mg
$ 560.00

ChemScene
Apcin 99.31%
25mg
$ 320.00

ChemScene
Apcin 99.31%
100mg
$ 980.00

Cayman Chemical
Apcin ≥98%
5mg
$ 102.00

Total 15 raw suppliers

Chemical Property of Apcin

Chemical Property:

PKA:9.67±0.46(Predicted)
PSA：139.78000
Density:1.68±0.1 g/cm3(Predicted)
LogP:3.41140
Storage Temp.:room temp
XLogP3:3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:437.017285
Heavy Atom Count:27
Complexity:513

Purity/Quality:

99%, ^*data from raw suppliers

Apcin ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=NC=C(N1CCOC(=O)NC(C(Cl)(Cl)Cl)NC2=NC=CC=N2)[N+](=O)[O-]
Uses Apcin is a novel inhibitor of the anaphase-promoting complex/cyclosome (APC/C), blocking mitotic exit and being synergistically amplified by co-addition of Ts-Arg-OMe.

Technology Process of Apcin

There total 5 articles about Apcin which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: C₁₃H₁₂N₄O₇

: 300815-04-7
apcin

Guidance literature:: Multi-step reaction with 4 steps

1: ammonium hydroxide / dichloromethane / 3 h / 0 - 10 °C / Inert atmosphere

2: 18 h / 20 - 100 °C / Inert atmosphere

3: triethylamine; thionyl chloride / dichloromethane / 0 °C / Reflux; Inert atmosphere

4: dichloromethane; acetonitrile / 20 - 60 °C / Inert atmosphere

With ammonium hydroxide; thionyl chloride; triethylamine; In dichloromethane; acetonitrile;
DOI:10.1021/acs.jmedchem.9b02097

Reference yield:

: 443-48-1
metronidazole

: 300815-04-7
apcin

Guidance literature:: Multi-step reaction with 5 steps

1: triethylamine / dichloromethane / 20 °C / Inert atmosphere

2: ammonium hydroxide / dichloromethane / 3 h / 0 - 10 °C / Inert atmosphere

3: 18 h / 20 - 100 °C / Inert atmosphere

4: triethylamine; thionyl chloride / dichloromethane / 0 °C / Reflux; Inert atmosphere

5: dichloromethane; acetonitrile / 20 - 60 °C / Inert atmosphere

With ammonium hydroxide; thionyl chloride; triethylamine; In dichloromethane; acetonitrile;
DOI:10.1021/acs.jmedchem.9b02097

Reference yield:

: 2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl (2,2,2-trichloro-1-hydroxyethyl)carbamate

: 300815-04-7
apcin

Guidance literature:: Multi-step reaction with 2 steps

1: triethylamine; thionyl chloride / dichloromethane / 0 °C / Reflux; Inert atmosphere

2: dichloromethane; acetonitrile / 20 - 60 °C / Inert atmosphere

With thionyl chloride; triethylamine; In dichloromethane; acetonitrile;
DOI:10.1021/acs.jmedchem.9b02097